Mixture of Acetonitrile + Cyclo-tris(diphenoxyphosphonitrile)

Excel

Acetonitrile

Name
Acetonitrile
InChI
InChI=1S/C2H3N/c1-2-3/h1H3
InChI Key
WEVYAHXRMPXWCK-UHFFFAOYSA-N
Formula
C2H3N
SMILES
CC#N
Mol. Weight (g/mol)
41.05
CAS
75-05-8

Cyclo-tris(diphenoxyphosphonitrile)

Name
Cyclo-tris(diphenoxyphosphonitrile)
InChI
InChI=1S/C36H30N3O6P3/c1-7-19-31(20-8-1)40-46(41-32-21-9-2-10-22-32)37-47(42-33-23-11-3-12-24-33,43-34-25-13-4-14-26-34)39-48(38-46,44-35-27-15-5-16-28-35)45-36-29-17-6-18-30-36/h1-30H
InChI Key
RNFJDJUURJAICM-UHFFFAOYSA-N
Formula
C36H30N3O6P3
SMILES
c1ccc(OP2(Oc3ccccc3)=NP(Oc3ccccc3)(Oc3ccccc3)=NP(Oc3ccccc3)(Oc3ccccc3)=N2)cc1
Mol. Weight (g/mol)
693.56
CAS
1184-10-7
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Datasets

  1. Mole fraction (2)

Mole fraction of Cyclo-tris(diphenoxyphosphonitrile) (2) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Cyclo-tris(diphenoxyphosphonitrile) (2) - Liquid
298.25 0.0040
303.55 0.0060
308.25 0.0082
313.35 0.0122
318.35 0.0170
323.45 0.0243
328.15 0.0332
333.25 0.0457

Mole fraction of Cyclo-tris(diphenoxyphosphonitrile) (2) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Cyclo-tris(diphenoxyphosphonitrile) (2) - Liquid
298.25 0.0040
303.55 0.0060
308.25 0.0082
313.35 0.0122
318.35 0.0170
323.45 0.0243
328.15 0.0332
333.25 0.0457

Sources